[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol

C16H26N2O3 — CID 102932082

IUPAC[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol
SMILESCOc1ccc(C(C(C)N)N2CC(C)OC(CO)C2)cc1
InChIInChI=1S/C16H26N2O3/c1-11-8-18(9-15(10-19)21-11)16(12(2)17)13-4-6-14(20-3)7-5-13/h4-7,11-12,15-16,19H,8-10,17H2,1-3H3
InChIKeyWMHOJDUZJYZOQP-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.17
Rot. Bonds5

About [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol

[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol (PubChem CID 102932082) has the molecular formula C16H26N2O3 and a molecular weight of 294.40 g/mol. Its IUPAC name is [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol
PubChem CID102932082
Molecular FormulaC16H26N2O3
Molecular Weight294.40 g/mol
Exact Mass294.19
IUPAC Name[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol
SMILESCOc1ccc(C(C(C)N)N2CC(C)OC(CO)C2)cc1
InChIInChI=1S/C16H26N2O3/c1-11-8-18(9-15(10-19)21-11)16(12(2)17)13-4-6-14(20-3)7-5-13/h4-7,11-12,15-16,19H,8-10,17H2,1-3H3
InChIKeyWMHOJDUZJYZOQP-UHFFFAOYSA-N
XLogP1.17
TPSA67.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[4-[2-amino-1-(3-methylphenyl)propyl]-6-methylmorpholin-2-yl]methanol
CID 102932113
[4-[2-amino-1-(4-bromophenyl)butyl]-6-methylmorpholin-2-yl]methanol
CID 102932098
[4-[2-amino-1-(4-bromothiophen-2-yl)propyl]-6-methylmorpholin-2-yl]methanol
CID 102932204
1-(4-methoxyphenyl)-1-(4-methylpiperidin-1-yl)propan-2-amine
CID 55016000
[4-[2-amino-1-(2-methylphenyl)butyl]-6-methylmorpholin-2-yl]methanol
CID 102932165
1-[3-(methoxymethyl)piperidin-1-yl]-1-(4-methoxyphenyl)propan-2-amine
CID 106585949
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-(4-methoxyphenoxy)ethanone
CID 102934536
1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-2-(4-methoxyphenyl)sulfanylethanone
CID 102934744
[4-[1-(3-aminophenyl)ethyl]-6-methylmorpholin-2-yl]methanol
CID 102932218
(E)-1-[2-(hydroxymethyl)-6-methylmorpholin-4-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
CID 102934428
1-(2,6-dimethylmorpholin-4-yl)-1-[4-(1-trimethylsilylethoxy)phenyl]propan-2-ol
CID 54253368
[4-[(2-fluoro-4-methoxyphenyl)methyl]-6-methylmorpholin-2-yl]methanol
CID 102935432

Frequently Asked Questions

What is the IUPAC name of [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol (CID 102932082) is [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol is COc1ccc(C(C(C)N)N2CC(C)OC(CO)C2)cc1.
What is the InChIKey of [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol?
The InChIKey is WMHOJDUZJYZOQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O3/c1-11-8-18(9-15(10-19)21-11)16(12(2)17)13-4-6-14(20-3)7-5-13/h4-7,11-12,15-16,19H,8-10,17H2,1-3H3.
What are the key properties of [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol?
[4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol has a molecular weight of 294.40 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-amino-1-(4-methoxyphenyl)propyl]-6-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 102932082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).